1219130-57-0 | 3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-boronic acid pinacol ester

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$137.00	$96.00
250mg	95%	in stock	$201.00	$141.00
1g	95%	in stock	$489.00	$342.00
5g	95%	in stock	$1,504.00	$1,053.00
25g	95%	in stock	$4,488.00	$3,142.00

Description

• Catalog Number: AA54749
• Chemical Name: 3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-boronic acid pinacol ester
• CAS Number: 1219130-57-0
• Molecular Formula: C14H18BNO4
• Molecular Weight: 275.108
• MDL Number: MFCD08063619
• SMILES: O=C1COc2c(N1)ccc(c2)B1OC(C(O1)(C)C)(C)C

Computed Properties

• Complexity: 396
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 20
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1

Upstream Synthesis Route

7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-benzo[b][1,4]oxazin-3(4H)-one is a versatile compound widely used in chemical synthesis as a key building block. Its unique structure containing a boron-containing heterocycle combined with a benzoxazine ring provides opportunities for diverse chemical transformations and functional group manipulations. In organic synthesis, this compound serves as an important intermediate in the creation of complex molecules and pharmaceuticals. Its strategic incorporation enables the introduction of boron functionality into target molecules, facilitating further modifications and enabling access to new chemical entities. Additionally, the presence of the oxazinone moiety offers a handle for stereochemical control and diversity-oriented synthesis. Overall, the application of 7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-benzo[b][1,4]oxazin-3(4H)-one in chemical synthesis represents a valuable tool for the construction of structurally complex and biologically active compounds.